| SpectraBase Compound ID | fnFweN8ora |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-4-7-11-14(10-5-2)22-18(20)16-13-9-8-12-15(16)17(19)21-6-3/h8-9,12-14H,4-7,10-11H2,1-3H3 |
| InChIKey | SSMOXUGCZFLHJB-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5IfwKCX3Y7Q |
|---|---|
| Name | Phthalic acid, ethyl 4-octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-4-7-11-14(10-5-2)22-18(20)16-13-9-8-12-15(16)17(19)21-6-3/h8-9,12-14H,4-7,10-11H2,1-3H3 |
| InChIKey | SSMOXUGCZFLHJB-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OC(CCCC)CCC)=O)C(OCC)=O |